Geometry & MOs

Info

ID:	59618
PubChem CID:	24890485
Reduced:	O2F3N7H18C25 (1)
Stoich.:	A2B3C7D18E25 (1)
Weight, g/mol:	370.12772
ΔH_f, kcal/mol:	-43.34
Dipole, Da:	4.87
IP(EA), eV:	-9.9(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-2-[(1,2-benzoxazol-3-ylmethylamino)-hydroxymethylidene]-9,9-dimethyl-6,7-dihydropyrimido[2,1-c][1,4]oxazine-3,4-dione

Drug info:

PubChemData

Smile

CC1=C(N=C(C(=O)N1C2=CC=CC(=C2)C(F)(F)F)C(=O)NC3CC3)C4=CC=NN4C5=CN=C(C=C5)C#N

DOS

IR

Vibrations